Compound C21H30O5

(8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-13-(hydroxymethyl)-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

CAS: 561-65-9

Molecular Formula	`C21H30O5`
Molecular Weight	362.5 g/mol
LogP	0.7
Topological Polar Surface Area	94.8 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	362.20932
Heavy Atoms	26
Complexity	655.0

Chemical Identifiers

CAS Number	561-65-9
SMILES	`CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4C(=O)CO)CO)O`
InChIKey	`HFSXHZZDNDGLQN-ZVIOFETBSA-N`

📖 Product Overview

Compound C21H30O5 (CAS: 561-65-9) is a chemical compound with molecular formula C21H30O5 and molecular weight 362.5 g/mol. Its IUPAC systematic name is (8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-13-(hydroxymethyl)-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one. LogP 0.7 Topological Polar Surface Area 94.8 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 362.20932 Heavy Atoms 26 Complexity 655.0 InChI Key: HFSXHZZDNDGLQN-ZVIOFETBSA-N. SMILES: CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4C(=O)CO)CO)O.

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